2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide

C10H18N2O4 — CID 103849532

IUPAC2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
SMILESCC(=O)NC(C)C(=O)NCC1(O)CCOC1
InChIInChI=1S/C10H18N2O4/c1-7(12-8(2)13)9(14)11-5-10(15)3-4-16-6-10/h7,15H,3-6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyFAPTXRNFYLKNTH-UHFFFAOYSA-N
MW230.26 g/mol
LogP-1.22
Rot. Bonds4

About 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide

2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide (PubChem CID 103849532) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide.

Molecular Properties

Compound Name2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
PubChem CID103849532
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
SMILESCC(=O)NC(C)C(=O)NCC1(O)CCOC1
InChIInChI=1S/C10H18N2O4/c1-7(12-8(2)13)9(14)11-5-10(15)3-4-16-6-10/h7,15H,3-6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyFAPTXRNFYLKNTH-UHFFFAOYSA-N
XLogP-1.22
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 106101394
3-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-2-methylpropanamide
CID 106101303
(2S)-2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-4-methylpentanamide
CID 106101485
N-[1-[(4-hydroxyoxan-4-yl)methylamino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 79039871
(2S)-2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-3,3-dimethylbutanamide
CID 106101444
N-[(3-hydroxyoxolan-3-yl)methyl]-2-propan-2-ylsulfanylacetamide
CID 103848866
2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]hexanamide
CID 106101365
2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
CID 106100495
(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 51715596
3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide
CID 106101375
2-chloro-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 106765719
2-acetamido-N-[[1-(hydroxymethyl)cyclohexyl]methyl]propanamide
CID 112699726

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide?
The IUPAC name of 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide (CID 103849532) is 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide.
What is the SMILES notation for 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide?
The canonical SMILES for 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide is CC(=O)NC(C)C(=O)NCC1(O)CCOC1.
What is the InChIKey of 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide?
The InChIKey is FAPTXRNFYLKNTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-7(12-8(2)13)9(14)11-5-10(15)3-4-16-6-10/h7,15H,3-6H2,1-2H3,(H,11,14)(H,12,13).
What are the key properties of 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide?
2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide has a molecular weight of 230.26 g/mol, XLogP of -1.22, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide is sourced from PubChem (CID 103849532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).